Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 5/20 | 0.35 |
| ▸ | RBP4 | P02753 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | SNCA | P37840 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9209368 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL9749046 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL9219326 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL9209366 | 1.00 | ALDH1A1 (0.53) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL23888737 | 0.96 | ALDH1A1 (0.51) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL23888738 | 0.96 | ALDH1A1 (0.51) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL9217106 | 0.89 | ALDH1A1 (0.51) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL9208605 | 0.89 | ALDH1A1 (0.51) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL9217111 | 0.89 | ALDH1A1 (0.51) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 | |
| SCHEMBL8388735 | 0.87 | ALDH1A1 (0.39) | ALDH1A1MAPTCYP3A4HPGDHSD17B10 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1031561-B1 | Manufacture of cycloalkenylpolyene esters | HOFFMANN LA ROCHE (CH) | 2003-05-14 | — | — | EP | disclosed |